SCHEMBL20509999

SCHEMBL20509999

COC(=O)C(C)Cc1ccc2c(c1)CCN(C(=O)O)CC2

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.44
PPARD Q03181 2/20 0.44
PPARA Q07869 1/20 0.43
HCRTR2 O43614 7/20 0.40
HCRTR1 O43613 3/20 0.39
HRH3 Q9Y5N1 1/20 0.39
NPC1 O15118 1/20 0.39
KMT2A Q03164 1/20 0.39
ACACB O00763 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
P2RX3 P56373 2/20 0.38
GPR183 P32249 1/20 0.38
ACE P12821 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20509998 1.00 PPARG (0.44) PPARGPPARDPPARAHCRTR2HCRTR1
SCHEMBL22504373 0.85 ESR2 (0.50) PPARGPPARDPPARAHCRTR2HCRTR1
SCHEMBL31281239 0.85 ESR2 (0.50) PPARGPPARDPPARAHCRTR2HCRTR1
SCHEMBL29124178 0.85 ESR2 (0.50) PPARGPPARDPPARAHCRTR2HCRTR1
SCHEMBL22504368 0.81 PPARG (0.45) PPARGPPARDPPARA
Hydrochloric Acid SCHEMBL31281225 0.80 PPARG (0.44) PPARGPPARDPPARA
SCHEMBL19423659 0.76 PNMT (0.42) PPARGPPARDPPARA
SCHEMBL22504328 0.76 PLAU (0.44) PPARGPPARDPPARA
SCHEMBL18584721 0.75 NAMPT (0.42) NPC1KMT2AHSD17B10HDAC6
SCHEMBL16015559 0.74 ALDH1A1 (0.45) PPARGPPARDPPARAKMT2AHSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11220483-B2 Tetrahydro-benzo[d]azepine derivatives as GPR120 modulators CALDAN THERAPEUTICS LTD (GB) 2022-01-11 US disclosed
US-20200317619-A1 TETRAHYDRO-BENZO[D]AZEPINE DERIVATIVES AS GPR120 MODULATORS CALDAN THERAPEUTICS LTD. (GB) 2020-10-08 US disclosed
EP-3601229-A1 TETRAHYDRO-BENZO[D]AZEPINE DERIVATIVES AS GPR120 MODULATORS Caldan Therapeutics Limited (GB) 2020-02-05 EP disclosed
WO-2018172727-A1 TETRAHYDRO-BENZO[D]AZEPINE DERIVATIVES AS GPR120 MODULATORS CALDAN THERAPEUTICS LIMITED (GB) 2018-09-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200317619-A1 TETRAHYDRO-BENZO[D]AZEPINE DERIVATIVES AS GPR120 MODULATORS GPR119, GPR84, GPR65 PPARG 62/4885PPARD 57/4885PPARA 233/4885
US-11220483-B2 Tetrahydro-benzo[d]azepine derivatives as GPR120 modulators GPR119, GPR84, GPR65 PPARG 63/4885PPARD 56/4885PPARA 241/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.